(phenylmethyl) (2S)-2-[[3-(1H-indol-7-yl)phenyl]carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2S)-2-[[3-(1H-indol-7-yl)phenyl]carbamoyl]pyrrolidine-1-carboxylate Openeye Name: benzyl (2S)-2-[[3-(1H-indol-7-yl)phenyl]carbamoyl]pyrrolidine-1-carboxylate CAS Name: (2S)-2-[[3-(1H-indol-7-yl)anilino]-oxomethyl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-[[3-(1H-indol-7-yl)phenyl]carbamoyl]pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[[3-(1H-indol-7-yl)phenyl]carbamoyl]pyrrolidine-1-carboxylic acid benzyl ester Formula: C27H25N3O3 MolecularWeight: 439.5057

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C4=CC=CC5=C4NC=C5

Isomeric SMILES

C1C[C@H](N(C1)C(=O)OCC2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C4=CC=CC5=C4NC=C5

InChI

InChI=1S/C27H25N3O3/c31-26(24-13-6-16-30(24)27(32)33-18-19-7-2-1-3-8-19)29-22-11-4-10-21(17-22)23-12-5-9-20-14-15-28-25(20)23/h1-5,7-12,14-15,17,24,28H,6,13,16,18H2,(H,29,31)/t24-/m0/s1